SCHEMBL8697223

SCHEMBL8697223

Fc1ccc(C(F)(c2cncnc2)c2ccco2)cc1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 13/20 0.56
USP2 O75604 1/20 0.31
RAB9A P51151 1/20 0.31
AR P10275 1/20 0.31
PLA2G7 Q13093 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8700104 0.88 CYP19A1 (0.45) CYP19A1
SCHEMBL8702199 0.87 CYP19A1 (0.45) CYP19A1RAB9AAR
SCHEMBL8696804 0.87 CYP19A1 (0.66) CYP19A1
SCHEMBL8700017 0.83 CYP19A1 (0.42) CYP19A1AR
SCHEMBL8697427 0.82 CYP19A1 (0.42) CYP19A1AR
SCHEMBL8702831 0.81 CYP19A1 (0.66) CYP19A1USP2RAB9A
SCHEMBL8697579 0.73 CYP19A1 (0.51) CYP19A1RAB9A
SCHEMBL8700003 0.73 CYP19A1 (0.58) CYP19A1RAB9A
SCHEMBL8700111 0.72 CYP3A4 (0.46) CYP19A1AR
SCHEMBL8697676 0.70 CYP19A1 (0.48) CYP19A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998018791-A1 HETEROCYCLIC FURAN COMPOUNDS, THEIR PREPARATION AND USE AS AROMATASE INHIBITORS A. MENARINI INDUSTRIE FARMACEUTICHE RIUNITE S.R.L. (IT) 1998-05-07 WO claimed
WO-1998018791-A1 HETEROCYCLIC FURAN COMPOUNDS, THEIR PREPARATION AND USE AS AROMATASE INHIBITORS A. MENARINI INDUSTRIE FARMACEUTICHE RIUNITE S.R.L. (IT) 1998-05-07 WO disclosed